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Title: Materials Data on Sr7Au3 by Materials Project

Dataset ·
DOI:https://doi.org/10.17188/1204831· OSTI ID:1204831

Sr7Au3 crystallizes in the hexagonal P6_3mc space group. The structure is three-dimensional. there are three inequivalent Sr sites. In the first Sr site, Sr is bonded in a distorted trigonal non-coplanar geometry to three equivalent Au atoms. All Sr–Au bond lengths are 3.20 Å. In the second Sr site, Sr is bonded in a distorted L-shaped geometry to two equivalent Au atoms. Both Sr–Au bond lengths are 3.25 Å. In the third Sr site, Sr is bonded in a distorted T-shaped geometry to three equivalent Au atoms. There are one shorter (3.25 Å) and two longer (3.27 Å) Sr–Au bond lengths. Au is bonded in a 6-coordinate geometry to six Sr atoms.

Research Organization:
Lawrence Berkeley National Lab. (LBNL), Berkeley, CA (United States). LBNL Materials Project
Sponsoring Organization:
USDOE Office of Science (SC), Basic Energy Sciences (BES)
Contributing Organization:
MIT; UC Berkeley; Duke; U Louvain
DOE Contract Number:
AC02-05CH11231; EDCBEE
OSTI ID:
1204831
Report Number(s):
mp-30422
Resource Relation:
Related Information: https://materialsproject.org/citing
Country of Publication:
United States
Language:
English

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